2188-2873 Screening compound: (2E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(2-hydroxy-4,5-dimethylphenyl)prop-2-en-1-one

2188-2873 Screening compound: (2E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(2-hydroxy-4,5-dimethylphenyl)prop-2-en-1-one
2188-2873 Screening compound: (2E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(2-hydroxy-4,5-dimethylphenyl)prop-2-en-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 2188-2873
(2E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(2-hydroxy-4,5-dimethylphenyl)prop-2-en-1-one

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

2188-2873

Molecular Formula

C19H18O4 (C19 H18 O4)

Compound Name

(2E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(2-hydroxy-4,5-dimethylphenyl)prop-2-en-1-one

IUPAC name

(2E)-3-(23-dihydro-14-benzodioxin-6-yl)-1-(2-hydroxy-45-dimethylphenyl)prop-2-en-1-one

SMILES

Cc(c(C)c1)cc(C(/C=C/c(cc2)cc3c2OCCO3)=O)c1O

InChI

InChI=1S/C19H18O4/c1-12-9-15(17(21)10-13(12)2)16(20)5-3-14-4-6-18-19(11-14)23-8-7-22-18/h3-6,9-11,21H,7-8H2,1-2H3

InChI Key

CJFLTJONXLEPQP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00192892

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

310.35

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.752

Distribution Coefficient, logD

3.744

Water Solubility, LogSw

-3.54

Polar Surface Area

45.585

Acid Dissociation Constant (pKa)

9.13

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

2188-2873 in Drug Discovery

Included in Screening Libraries

CORONAVIRUS Library (20774 compounds)

KRAS-Targeted Library (16000 compounds)

PLpro Library (6343 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Antiviral
  • Infections
  • Immune system
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 2188-2873 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2188-2873?
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What is the minimum amount of 2188-2873 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2188-2873
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2188-2873
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 2188-2873 available by request